Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pmp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLU 4.A OE1 no hydrogen 2.761 N/A GLU 4.A N GLU 4.A OE1 no hydrogen 2.771 N/A ASP 5.A N ASN 1.A O no hydrogen 3.083 N/A HIS 6.A N GLU 2.A O no hydrogen 2.894 N/A LEU 7.A N THR 3.A O no hydrogen 2.913 N/A GLU 8.A N GLU 4.A O no hydrogen 2.924 N/A SER 9.A N ASP 5.A O no hydrogen 2.898 N/A SER 9.A OG ASP 5.A O no hydrogen 2.942 N/A SER 9.A OG GLU 8.A OE1 no hydrogen 3.540 N/A LEU 10.A N HIS 6.A O no hydrogen 2.915 N/A ILE 11.A N LEU 7.A O no hydrogen 2.916 N/A CYS 12.A N GLU 8.A O no hydrogen 2.911 N/A CYS 12.A SG GLU 8.A O no hydrogen 3.258 N/A CYS 12.A SG GLU 8.A OE2 no hydrogen 3.539 N/A LYS 13.A N SER 9.A O no hydrogen 2.916 N/A SER 18.A OG CYS 20.A O no hydrogen 3.137 N/A GLU 23.A N GLU 23.A OE1 no hydrogen 2.693 N/A SER 24.A OG SER 21.A O no hydrogen 2.336 N/A ASN 25.A N SER 21.A O no hydrogen 3.201 N/A LEU 26.A N LEU 22.A O no hydrogen 2.966 N/A GLU 27.A N GLU 23.A O no hydrogen 2.893 N/A GLY 28.A N SER 24.A O no hydrogen 2.899 N/A LEU 29.A N ASN 25.A O no hydrogen 2.913 N/A ALA 30.A N LEU 26.A O no hydrogen 2.886 N/A GLY 31.A N GLU 27.A O no hydrogen 2.907 N/A VAL 32.A N GLY 28.A O no hydrogen 2.957 N/A LEU 33.A N LEU 29.A O no hydrogen 2.855 N/A GLU 34.A N ALA 30.A O no hydrogen 2.899 N/A ALA 35.A N GLY 31.A O no hydrogen 2.868 N/A ASP 36.A N VAL 32.A O no hydrogen 2.981 N/A ASP 36.A N LEU 33.A O no hydrogen 3.099 N/A LEU 37.A N GLU 34.A O no hydrogen 3.513 N/A TYR 40.A N ASP 36.A O no hydrogen 3.259 N/A TYR 40.A N LEU 37.A O no hydrogen 3.286 N/A ILE 44.A N TYR 40.A O no hydrogen 3.072 N/A LEU 45.A N LYS 41.A O no hydrogen 2.928 N/A ARG 46.A N SER 42.A O no hydrogen 2.897 N/A LEU 47.A N LYS 43.A O no hydrogen 2.957 N/A LEU 48.A N ILE 44.A O no hydrogen 2.875 N/A CYS 49.A N LEU 45.A O no hydrogen 2.972 N/A CYS 49.A SG LEU 45.A O no hydrogen 3.664 N/A THR 50.A N ARG 46.A O no hydrogen 2.915 N/A THR 50.A OG1 ARG 46.A O no hydrogen 3.378 N/A VAL 51.A N LEU 47.A O no hydrogen 2.910 N/A ALA 52.A N LEU 48.A O no hydrogen 2.860 N/A ARG 53.A N THR 50.A O no hydrogen 3.224 N/A ARG 53.A NE GLN 87.A OE1 no hydrogen 3.077 N/A ARG 53.A NH1 GLU 99.A OE1 no hydrogen 3.335 N/A ARG 53.A NH1 GLU 99.A OE2 no hydrogen 2.934 N/A LEU 54.A N THR 50.A O no hydrogen 2.921 N/A GLU 57.A N GLU 57.A OE1 no hydrogen 2.714 N/A LYS 58.A N LEU 55.A O no hydrogen 3.205 N/A LEU 59.A N PRO 56.A O no hydrogen 2.954 N/A TYR 62.A N LYS 58.A O no hydrogen 3.284 N/A THR 63.A N LEU 59.A O no hydrogen 3.415 N/A THR 63.A OG1 LEU 59.A O no hydrogen 2.059 N/A THR 63.A OG1 THR 60.A O no hydrogen 3.398 N/A THR 64.A N THR 60.A O no hydrogen 2.988 N/A LEU 65.A N ILE 61.A O no hydrogen 3.218 N/A VAL 66.A N TYR 62.A O no hydrogen 2.845 N/A GLY 67.A N THR 63.A O no hydrogen 3.152 N/A GLY 67.A N THR 64.A O no hydrogen 2.918 N/A LEU 68.A N THR 64.A O no hydrogen 3.277 N/A LEU 69.A N LEU 65.A O no hydrogen 3.240 N/A ASN 70.A N VAL 66.A O no hydrogen 3.252 N/A ASN 70.A ND2 HIS 242.A ND1 no hydrogen 3.207 N/A ALA 71.A N GLY 67.A O no hydrogen 2.760 N/A ARG 72.A N LEU 68.A O no hydrogen 3.010 N/A ARG 72.A N LEU 69.A O no hydrogen 2.928 N/A ASN 73.A N LEU 69.A O no hydrogen 2.806 N/A ASN 73.A N ASN 70.A O no hydrogen 3.048 N/A GLY 78.A N TYR 74.A O no hydrogen 2.942 N/A GLU 79.A N ASN 75.A O no hydrogen 2.938 N/A PHE 80.A N PHE 76.A O no hydrogen 2.841 N/A VAL 81.A N GLY 77.A O no hydrogen 2.919 N/A GLU 82.A N GLY 78.A O no hydrogen 2.961 N/A ALA 83.A N GLU 79.A O no hydrogen 2.889 N/A MET 84.A N PHE 80.A O no hydrogen 2.890 N/A ILE 85.A N VAL 81.A O no hydrogen 2.926 N/A ARG 86.A N GLU 82.A O no hydrogen 2.980 N/A GLN 87.A N ALA 83.A O no hydrogen 2.832 N/A GLN 87.A NE2 GLN 87.A O no hydrogen 3.551 N/A LEU 88.A N MET 84.A O no hydrogen 2.847 N/A LYS 89.A N ILE 85.A O no hydrogen 2.917 N/A GLU 90.A N ARG 86.A O no hydrogen 2.943 N/A SER 91.A N GLN 87.A O no hydrogen 2.843 N/A LEU 92.A N LEU 88.A O no hydrogen 2.902 N/A LYS 93.A N LYS 89.A O no hydrogen 2.928 N/A ALA 94.A N GLU 90.A O no hydrogen 2.834 N/A ALA 94.A N SER 91.A O no hydrogen 3.238 N/A ASN 95.A ND2 ASP 255.A O no hydrogen 3.348 N/A ASN 96.A N SER 91.A O no hydrogen 3.347 N/A GLU 99.A N ASN 96.A OD1 no hydrogen 3.151 N/A VAL 101.A N TYR 97.A O no hydrogen 2.951 N/A TYR 102.A N ASN 98.A O no hydrogen 3.024 N/A LEU 103.A N GLU 99.A O no hydrogen 2.854 N/A VAL 104.A N ALA 100.A O no hydrogen 2.981 N/A ARG 105.A N VAL 101.A O no hydrogen 2.912 N/A ARG 105.A NH1 GLU 292.A OE2 no hydrogen 3.372 N/A ARG 105.A NH2 GLU 292.A OE2 no hydrogen 3.232 N/A PHE 106.A N TYR 102.A O no hydrogen 2.866 N/A LEU 107.A N LEU 103.A O no hydrogen 2.904 N/A SER 108.A N VAL 104.A O no hydrogen 2.951 N/A SER 108.A OG VAL 104.A O no hydrogen 2.994 N/A ASP 109.A N ARG 105.A O no hydrogen 2.941 N/A LEU 110.A N PHE 106.A O no hydrogen 2.791 N/A VAL 111.A N LEU 107.A O no hydrogen 2.878 N/A ASN 112.A N SER 108.A O no hydrogen 3.094 N/A ASN 112.A ND2 ASP 109.A OD1 no hydrogen 2.958 N/A ASN 112.A ND2 TRP 155.A O no hydrogen 2.317 N/A CYS 113.A N LEU 110.A O no hydrogen 2.959 N/A CYS 113.A SG THR 63.A O no hydrogen 3.694 N/A CYS 113.A SG ASP 109.A O no hydrogen 3.332 N/A HIS 114.A N VAL 111.A O no hydrogen 3.169 N/A ALA 117.A N HIS 242.A O no hydrogen 2.672 N/A SER 120.A OG LEU 244.A O no hydrogen 2.849 N/A VAL 122.A N ALA 118.A O no hydrogen 2.878 N/A ALA 123.A N PRO 119.A O no hydrogen 2.910 N/A MET 124.A N SER 120.A O no hydrogen 2.946 N/A PHE 125.A N MET 121.A O no hydrogen 2.894 N/A GLU 126.A N VAL 122.A O no hydrogen 2.870 N/A ASN 127.A N ALA 123.A O no hydrogen 2.924 N/A ASN 127.A ND2 ALA 123.A O no hydrogen 2.670 N/A PHE 128.A N MET 124.A O no hydrogen 2.941 N/A VAL 129.A N PHE 125.A O no hydrogen 2.921 N/A SER 130.A N GLU 126.A O no hydrogen 2.858 N/A SER 130.A OG GLU 126.A O no hydrogen 2.791 N/A SER 130.A OG ASN 127.A O no hydrogen 2.651 N/A VAL 131.A N ASN 127.A O no hydrogen 2.983 N/A VAL 131.A N PHE 128.A O no hydrogen 3.109 N/A THR 132.A N VAL 129.A O no hydrogen 2.804 N/A THR 132.A OG1 VAL 129.A O no hydrogen 2.733 N/A GLN 133.A N SER 130.A O no hydrogen 2.784 N/A GLU 134.A N VAL 131.A O no hydrogen 3.080 N/A GLN 139.A NE2 GLN 183.A O no hydrogen 3.292 N/A ARG 141.A NH1 GLU 134.A OE1 no hydrogen 2.805 N/A ARG 141.A NH2 PRO 250.A O no hydrogen 2.353 N/A ARG 142.A NE VAL 137.A O no hydrogen 3.503 N/A ASP 143.A N GLN 139.A O no hydrogen 2.934 N/A TRP 144.A N VAL 140.A O no hydrogen 2.940 N/A TYR 145.A N ARG 141.A O no hydrogen 2.907 N/A VAL 146.A N ARG 142.A O no hydrogen 2.959 N/A TYR 147.A N ASP 143.A O no hydrogen 2.837 N/A ALA 148.A N TRP 144.A O no hydrogen 2.844 N/A PHE 149.A N TYR 145.A O no hydrogen 2.998 N/A LEU 150.A N VAL 146.A O no hydrogen 2.896 N/A SER 151.A N TYR 147.A O no hydrogen 2.824 N/A SER 152.A N ALA 148.A O no hydrogen 2.887 N/A SER 152.A OG PHE 149.A O no hydrogen 2.718 N/A LEU 153.A N PHE 149.A O no hydrogen 3.033 N/A TRP 155.A N SER 152.A O no hydrogen 3.223 N/A VAL 156.A N LEU 153.A O no hydrogen 3.115 N/A GLY 157.A N LEU 153.A O no hydrogen 2.858 N/A LYS 158.A NZ ARG 219.A O no hydrogen 3.513 N/A LYS 158.A NZ GLN 221.A OE1 no hydrogen 2.643 N/A LEU 160.A N VAL 156.A O no hydrogen 3.015 N/A TYR 161.A N GLY 157.A O no hydrogen 2.893 N/A TYR 161.A OH ASP 169.A OD1 no hydrogen 2.666 N/A TYR 161.A OH ASP 169.A OD2 no hydrogen 3.346 N/A GLU 162.A N LYS 158.A O no hydrogen 2.903 N/A LYS 163.A N GLU 159.A O no hydrogen 2.972 N/A LYS 163.A N LEU 160.A O no hydrogen 3.246 N/A LYS 163.A NZ GLU 159.A OE2 no hydrogen 2.783 N/A LYS 164.A N LEU 160.A O no hydrogen 2.850 N/A MET 168.A N LYS 164.A O no hydrogen 2.917 N/A ASP 169.A N ASP 165.A O no hydrogen 2.846 N/A ARG 170.A N ALA 166.A O no hydrogen 3.001 N/A ILE 171.A N GLU 167.A O no hydrogen 2.882 N/A PHE 172.A N MET 168.A O no hydrogen 2.860 N/A ALA 173.A N ASP 169.A O no hydrogen 2.904 N/A ASN 174.A N ARG 170.A O no hydrogen 2.962 N/A THR 175.A N ILE 171.A O no hydrogen 2.901 N/A THR 175.A OG1 ILE 171.A O no hydrogen 3.493 N/A THR 175.A OG1 PHE 172.A O no hydrogen 2.474 N/A GLU 176.A N PHE 172.A O no hydrogen 2.907 N/A SER 177.A N ALA 173.A O no hydrogen 2.896 N/A TYR 178.A N ASN 174.A O no hydrogen 2.950 N/A TYR 178.A OH ASP 143.A OD1 no hydrogen 2.208 N/A LEU 179.A N THR 175.A O no hydrogen 2.858 N/A LYS 180.A N GLU 176.A O no hydrogen 2.939 N/A ARG 181.A N TYR 178.A O no hydrogen 3.017 N/A ARG 181.A NH1 SER 177.A O no hydrogen 2.873 N/A ARG 182.A N LEU 179.A O no hydrogen 3.429 N/A ARG 182.A NE ASP 143.A OD1 no hydrogen 2.736 N/A ARG 182.A NH1 GLU 203.A OE1 no hydrogen 2.369 N/A ARG 182.A NH1 GLU 203.A OE2 no hydrogen 3.464 N/A ARG 182.A NH2 ASP 143.A OD2 no hydrogen 2.670 N/A ARG 182.A NH2 GLU 203.A OE2 no hydrogen 2.606 N/A GLN 183.A N GLN 139.A OE1 no hydrogen 3.070 N/A LYS 184.A NZ ASP 206.A OD1 no hydrogen 3.483 N/A LYS 184.A NZ ASP 206.A OD2 no hydrogen 2.598 N/A HIS 186.A NE2 GLU 203.A OE2 no hydrogen 2.576 N/A VAL 187.A N LYS 184.A O no hydrogen 3.205 N/A LEU 190.A N VAL 187.A O no hydrogen 2.887 N/A GLN 191.A N VAL 187.A O no hydrogen 2.931 N/A GLN 191.A NE2 GLN 201.A O no hydrogen 2.994 N/A THR 194.A N THR 380.A OG1 no hydrogen 3.152 N/A GLN 201.A NE2 HIS 199.A O no hydrogen 2.896 N/A GLN 201.A NE2 ARG 266.A O no hydrogen 2.718 N/A TYR 204.A N ARG 262.A O no hydrogen 3.308 N/A CYS 207.A N GLU 203.A O no hydrogen 3.084 N/A CYS 207.A SG SER 282.A O no hydrogen 3.829 N/A LEU 208.A N TYR 204.A O no hydrogen 2.874 N/A TRP 209.A N LEU 205.A O no hydrogen 2.870 N/A ALA 210.A N ASP 206.A O no hydrogen 2.918 N/A GLN 211.A N CYS 207.A O no hydrogen 2.920 N/A GLN 211.A NE2 SER 282.A O no hydrogen 2.974 N/A ILE 212.A N LEU 208.A O no hydrogen 2.896 N/A GLN 213.A N TRP 209.A O no hydrogen 2.881 N/A LYS 214.A N ALA 210.A O no hydrogen 2.924 N/A LEU 215.A N GLN 211.A O no hydrogen 2.890 N/A LYS 216.A N ILE 212.A O no hydrogen 2.880 N/A LYS 216.A NZ ASP 169.A OD1 no hydrogen 3.417 N/A LYS 217.A N GLN 213.A O no hydrogen 2.931 N/A ASP 218.A N LYS 214.A O no hydrogen 3.014 N/A ARG 219.A N LYS 216.A O no hydrogen 3.106 N/A TRP 220.A N LEU 215.A O no hydrogen 2.896 N/A HIS 224.A NE2 TYR 315.A OH no hydrogen 3.216 N/A ARG 227.A NH1 TRP 155.A O no hydrogen 3.280 N/A ARG 227.A NH1 TYR 229.A OH no hydrogen 3.172 N/A LEU 230.A N ARG 227.A O no hydrogen 3.182 N/A ALA 231.A N PRO 228.A O no hydrogen 3.266 N/A SER 234.A N ASP 233.A OD1 no hydrogen 2.290 N/A SER 234.A OG ASP 233.A OD1 no hydrogen 3.360 N/A LEU 236.A N PHE 232.A O no hydrogen 3.139 N/A CYS 237.A N ASP 233.A O no hydrogen 2.840 N/A CYS 237.A SG ASP 233.A O no hydrogen 3.036 N/A GLU 238.A N SER 234.A O no hydrogen 2.981 N/A GLU 238.A N ILE 235.A O no hydrogen 3.160 N/A ALA 239.A N LEU 236.A O no hydrogen 2.986 N/A GLN 241.A NE2 HIS 114.A ND1 no hydrogen 3.618 N/A HIS 242.A N VAL 115.A O no hydrogen 2.583 N/A HIS 252.A ND1 TYR 258.A OH no hydrogen 2.556 N/A THR 253.A N SER 256.A OG no hydrogen 3.428 N/A THR 253.A OG1 ASP 255.A OD1 no hydrogen 2.885 N/A GLU 254.A N GLU 254.A OE2 no hydrogen 2.628 N/A SER 256.A N THR 253.A O no hydrogen 3.116 N/A SER 256.A OG THR 253.A O no hydrogen 2.311 N/A SER 256.A OG THR 253.A OG1 no hydrogen 3.372 N/A SER 256.A OG TYR 258.A OH no hydrogen 3.194 N/A TYR 258.A OH HIS 252.A ND1 no hydrogen 2.556 N/A ARG 266.A N GLN 201.A OE1 no hydrogen 3.187 N/A ARG 266.A NH1 GLU 329.A OE2 no hydrogen 2.964 N/A TYR 270.A N ASP 269.A OD1 no hydrogen 2.498 N/A ASP 272.A N ASP 269.A O no hydrogen 2.872 N/A ASP 273.A N TYR 270.A O no hydrogen 3.160 N/A GLY 276.A N ASP 273.A OD1 no hydrogen 2.672 N/A HIS 283.A NE2 GLU 202.A OE2 no hydrogen 2.931 N/A SER 284.A N GLY 281.A O no hydrogen 3.077 N/A SER 284.A OG GLY 281.A O no hydrogen 2.343 N/A GLU 286.A N GLU 286.A OE1 no hydrogen 2.772 N/A ARG 287.A N SER 284.A O no hydrogen 3.028 N/A ARG 287.A NH1 PRO 280.A O no hydrogen 2.515 N/A ARG 287.A NH2 GLU 329.A OE1 no hydrogen 3.006 N/A VAL 289.A N VAL 285.A O no hydrogen 2.948 N/A ILE 290.A N GLU 286.A O no hydrogen 2.913 N/A GLU 291.A N ARG 287.A O no hydrogen 2.996 N/A GLU 292.A N PHE 288.A O no hydrogen 2.899 N/A ASN 293.A N VAL 289.A O no hydrogen 2.887 N/A ASN 293.A ND2 TYR 315.A OH no hydrogen 2.400 N/A LEU 294.A N ILE 290.A O no hydrogen 2.958 N/A HIS 295.A N GLU 291.A O no hydrogen 2.904 N/A CYS 296.A N GLU 292.A O no hydrogen 2.930 N/A CYS 296.A SG TYR 102.A OH no hydrogen 3.190 N/A CYS 296.A SG GLU 292.A O no hydrogen 3.203 N/A ILE 297.A N ASN 293.A O no hydrogen 2.904 N/A ILE 298.A N LEU 294.A O no hydrogen 2.932 N/A LYS 299.A N HIS 295.A O no hydrogen 2.908 N/A SER 300.A N CYS 296.A O no hydrogen 2.894 N/A SER 300.A OG LEU 54.A O no hydrogen 3.445 N/A SER 300.A OG CYS 296.A O no hydrogen 3.285 N/A ARG 305.A NE GLU 354.A OE2 no hydrogen 3.555 N/A THR 307.A OG1 GLU 304.A OE1 no hydrogen 3.517 N/A CYS 308.A N GLU 304.A O no hydrogen 2.907 N/A ALA 309.A N ARG 305.A O no hydrogen 2.928 N/A ALA 310.A N LYS 306.A O no hydrogen 2.925 N/A GLN 311.A N THR 307.A O no hydrogen 2.885 N/A LEU 312.A N CYS 308.A O no hydrogen 2.936 N/A VAL 313.A N ALA 309.A O no hydrogen 2.927 N/A SER 314.A N ALA 310.A O no hydrogen 3.218 N/A SER 314.A OG ALA 310.A O no hydrogen 2.944 N/A SER 314.A OG GLN 311.A O no hydrogen 3.568 N/A TYR 315.A N LEU 312.A O no hydrogen 3.334 N/A TYR 315.A OH HIS 224.A NE2 no hydrogen 3.216 N/A LYS 318.A N HIS 224.A O no hydrogen 3.175 N/A ASN 319.A ND2 ARG 223.A O no hydrogen 2.358 N/A ASN 324.A ND2 GLN 359.A OE1 no hydrogen 2.796 N/A HIS 326.A N PRO 322.A O no hydrogen 3.301 N/A ILE 327.A N LEU 323.A O no hydrogen 2.900 N/A VAL 328.A N ASN 324.A O no hydrogen 2.972 N/A GLU 329.A N TYR 325.A O no hydrogen 2.863 N/A VAL 330.A N HIS 326.A O no hydrogen 2.898 N/A ILE 331.A N ILE 327.A O no hydrogen 2.921 N/A PHE 332.A N VAL 328.A O no hydrogen 2.933 N/A ALA 333.A N GLU 329.A O no hydrogen 2.865 N/A GLU 334.A N VAL 330.A O no hydrogen 2.918 N/A LEU 335.A N ILE 331.A O no hydrogen 2.930 N/A PHE 336.A N PHE 332.A O no hydrogen 2.884 N/A GLN 337.A N ALA 333.A O no hydrogen 2.901 N/A GLN 337.A NE2 ALA 340.A O no hydrogen 3.192 N/A HIS 343.A N TYR 348.A OH no hydrogen 2.518 N/A MET 347.A N ILE 344.A O no hydrogen 2.693 N/A TYR 348.A OH HIS 343.A ND1 no hydrogen 3.123 N/A THR 349.A N ASP 345.A O no hydrogen 3.052 N/A THR 350.A N VAL 346.A O no hydrogen 2.943 N/A THR 350.A OG1 VAL 346.A O no hydrogen 2.804 N/A THR 350.A OG1 MET 347.A O no hydrogen 2.681 N/A LEU 351.A N MET 347.A O no hydrogen 2.856 N/A LEU 352.A N TYR 348.A O no hydrogen 2.916 N/A ILE 353.A N THR 349.A O no hydrogen 2.944 N/A GLU 354.A N THR 350.A O no hydrogen 2.904 N/A LEU 355.A N LEU 351.A O no hydrogen 2.879 N/A CYS 356.A N LEU 352.A O no hydrogen 2.921 N/A CYS 356.A SG LEU 352.A O no hydrogen 3.208 N/A LYS 357.A N ILE 353.A O no hydrogen 2.933 N/A LYS 357.A NZ GLU 354.A OE2 no hydrogen 3.312 N/A LEU 358.A N GLU 354.A O no hydrogen 2.901 N/A GLN 359.A N LEU 355.A O no hydrogen 2.940 N/A SER 362.A OG ASN 324.A OD1 no hydrogen 3.165 N/A LEU 363.A N GLN 359.A O no hydrogen 3.165 N/A VAL 366.A N SER 362.A O no hydrogen 3.461 N/A LEU 367.A N LEU 363.A O no hydrogen 2.874 N/A ALA 368.A N PRO 364.A O no hydrogen 2.918 N/A GLN 369.A N GLN 365.A O no hydrogen 2.895 N/A ALA 370.A N VAL 366.A O no hydrogen 2.885 N/A THR 371.A N LEU 367.A O no hydrogen 2.883 N/A THR 371.A OG1 LEU 367.A O no hydrogen 2.857 N/A GLU 372.A N ALA 368.A O no hydrogen 2.945 N/A MET 373.A N GLN 369.A O no hydrogen 2.882 N/A LEU 374.A N ALA 370.A O no hydrogen 2.876 N/A TYR 375.A N THR 371.A O no hydrogen 2.941 N/A MET 376.A N GLU 372.A O no hydrogen 2.904 N/A ARG 377.A N LEU 374.A O no hydrogen 3.180 N/A ARG 377.A NH1 MET 267.A O no hydrogen 3.465 N/A ARG 377.A NH2 MET 267.A O no hydrogen 3.504 N/A LEU 378.A N TYR 375.A O no hydrogen 3.220 N/A ASN 382.A N VAL 192.A O no hydrogen 2.962 N/A ASN 382.A ND2 GLN 705.A OE1 no hydrogen 3.423 N/A THR 383.A OG1 GLU 702.A OE1 no hydrogen 2.413 N/A THR 384.A N ASN 382.A OD1 no hydrogen 2.770 N/A THR 384.A OG1 ASN 382.A OD1 no hydrogen 3.239 N/A CYS 385.A SG PHE 336.A O no hydrogen 3.484 N/A VAL 386.A N ASN 382.A O no hydrogen 2.796 N/A ASP 387.A N THR 383.A O no hydrogen 2.851 N/A ARG 388.A N THR 384.A O no hydrogen 2.974 N/A ARG 388.A NH1 LEU 335.A O no hydrogen 2.965 N/A ARG 388.A NH1 GLN 337.A O no hydrogen 2.702 N/A ARG 388.A NH2 PRO 339.A O no hydrogen 2.577 N/A PHE 389.A N CYS 385.A O no hydrogen 2.863 N/A ILE 390.A N VAL 386.A O no hydrogen 2.877 N/A ASN 391.A N ASP 387.A O no hydrogen 2.964 N/A TRP 392.A N ARG 388.A O no hydrogen 2.906 N/A PHE 393.A N PHE 389.A O no hydrogen 2.845 N/A SER 394.A N ILE 390.A O no hydrogen 2.903 N/A SER 394.A OG ASN 391.A O no hydrogen 2.962 N/A HIS 395.A N ASN 391.A O no hydrogen 3.005 N/A HIS 396.A N TRP 392.A O no hydrogen 2.831 N/A LEU 397.A N PHE 393.A O no hydrogen 2.860 N/A SER 398.A N SER 394.A O no hydrogen 2.879 N/A SER 398.A OG HIS 395.A O no hydrogen 2.462 N/A SER 398.A OG ASN 399.A OD1 no hydrogen 3.389 N/A ASN 399.A N HIS 395.A O no hydrogen 3.003 N/A PHE 400.A N LEU 397.A O no hydrogen 2.525 N/A GLN 401.A N SER 398.A O no hydrogen 3.210 N/A ARG 403.A NH2 GLN 401.A OE1 no hydrogen 3.532 N/A SER 405.A OG ASP 408.A OD2 no hydrogen 2.921 N/A ASP 408.A N SER 405.A O no hydrogen 2.981 N/A TRP 409.A N TRP 406.A O no hydrogen 2.880 N/A SER 410.A N GLU 407.A O no hydrogen 2.925 N/A CYS 412.A N TRP 409.A O no hydrogen 3.014 N/A CYS 412.A SG TYR 375.A OH no hydrogen 3.693 N/A CYS 412.A SG TRP 409.A O no hydrogen 3.073 N/A LEU 413.A N SER 410.A O no hydrogen 2.946 N/A SER 414.A N ASP 411.A O no hydrogen 2.947 N/A SER 414.A OG ASP 411.A O no hydrogen 2.461 N/A GLN 415.A N ASP 411.A O no hydrogen 3.478 N/A SER 419.A N ASP 416.A O no hydrogen 3.098 N/A SER 419.A OG GLN 415.A OE1 no hydrogen 3.449 N/A LYS 423.A N SER 419.A O no hydrogen 2.993 N/A LYS 423.A NZ THR 599.A O no hydrogen 2.683 N/A LYS 423.A NZ THR 599.A OG1 no hydrogen 3.106 N/A PHE 424.A N PRO 420.A O no hydrogen 2.863 N/A VAL 425.A N LYS 421.A O no hydrogen 2.936 N/A ARG 426.A N PRO 422.A O no hydrogen 2.890 N/A GLU 427.A N LYS 423.A O no hydrogen 2.932 N/A VAL 428.A N PHE 424.A O no hydrogen 2.878 N/A LEU 429.A N VAL 425.A O no hydrogen 2.918 N/A GLU 430.A N ARG 426.A O no hydrogen 2.888 N/A LYS 431.A N GLU 427.A O no hydrogen 2.910 N/A LYS 431.A NZ ASN 391.A OD1 no hydrogen 3.332 N/A LYS 431.A NZ GLU 605.A OE1 no hydrogen 3.381 N/A LYS 431.A NZ GLU 605.A OE2 no hydrogen 2.490 N/A CYS 432.A N VAL 428.A O no hydrogen 2.862 N/A CYS 432.A SG VAL 428.A O no hydrogen 3.075 N/A MET 433.A N LEU 429.A O no hydrogen 2.881 N/A ARG 434.A N GLU 430.A O no hydrogen 2.905 N/A ARG 434.A NH1 GLU 605.A OE1 no hydrogen 2.996 N/A LEU 435.A N LYS 431.A O no hydrogen 3.176 N/A LEU 435.A N CYS 432.A O no hydrogen 3.111 N/A SER 436.A N MET 433.A O no hydrogen 2.777 N/A TYR 437.A N SER 436.A OG no hydrogen 2.592 N/A HIS 438.A NE2 PRO 454.A O no hydrogen 2.535 N/A ARG 440.A NH1 TYR 437.A OH no hydrogen 3.481 N/A ILE 441.A N TYR 437.A O no hydrogen 3.163 N/A LEU 442.A N HIS 438.A O no hydrogen 2.943 N/A ASP 443.A N GLN 439.A O no hydrogen 2.902 N/A ILE 444.A N ARG 440.A O no hydrogen 2.929 N/A VAL 445.A N ILE 441.A O no hydrogen 2.864 N/A PHE 449.A N PRO 446.A O no hydrogen 3.072 N/A SER 450.A N PRO 447.A O no hydrogen 2.914 N/A SER 450.A OG PRO 447.A O no hydrogen 2.703 N/A LEU 452.A N PHE 449.A O no hydrogen 2.871 N/A CYS 453.A N SER 450.A O no hydrogen 3.174 N/A CYS 453.A SG PHE 449.A O no hydrogen 3.936 N/A THR 458.A N ASN 456.A O no hydrogen 2.975 N/A CYS 459.A SG ALA 522.A O no hydrogen 3.519 N/A ILE 460.A N VAL 559.A O no hydrogen 3.237 N/A LYS 462.A N GLN 515.A OE1 no hydrogen 3.426 N/A LYS 462.A NZ GLU 511.A OE2 no hydrogen 2.876 N/A GLY 464.A N TYR 461.A O no hydrogen 3.310 N/A GLU 466.A N ASP 465.A OD1 no hydrogen 2.437 N/A SER 467.A N GLY 464.A O no hydrogen 2.885 N/A SER 467.A OG LYS 462.A O no hydrogen 3.182 N/A SER 467.A OG SER 468.A O no hydrogen 3.286 N/A ASN 469.A ND2 HIS 474.A ND1 no hydrogen 2.957 N/A ALA 477.A N GLY 473.A O no hydrogen 2.757 N/A LEU 478.A N HIS 474.A O no hydrogen 2.911 N/A CYS 479.A N SER 475.A O no hydrogen 2.905 N/A LEU 480.A N VAL 476.A O no hydrogen 2.893 N/A ALA 481.A N ALA 477.A O no hydrogen 2.899 N/A VAL 482.A N LEU 478.A O no hydrogen 2.933 N/A ALA 483.A N CYS 479.A O no hydrogen 2.894 N/A PHE 484.A N LEU 480.A O no hydrogen 2.847 N/A LYS 485.A N ALA 481.A O no hydrogen 3.022 N/A LYS 485.A NZ ALA 481.A O no hydrogen 2.977 N/A SER 486.A N ALA 483.A O no hydrogen 2.798 N/A SER 486.A OG SER 486.A O no hydrogen 2.468 N/A LYS 487.A N PHE 484.A O no hydrogen 3.307 N/A ALA 488.A N ALA 483.A O no hydrogen 3.059 N/A THR 489.A N GLU 492.A OE1 no hydrogen 3.242 N/A ILE 493.A N THR 489.A O no hydrogen 3.139 N/A PHE 494.A N ASN 490.A O no hydrogen 2.886 N/A SER 495.A N ASP 491.A O no hydrogen 2.950 N/A SER 495.A OG GLU 492.A O no hydrogen 2.561 N/A ILE 496.A N GLU 492.A O no hydrogen 2.906 N/A LEU 497.A N ILE 493.A O no hydrogen 2.867 N/A LYS 498.A N SER 495.A O no hydrogen 3.190 N/A ILE 510.A N ASN 506.A O no hydrogen 3.190 N/A GLU 511.A N PRO 507.A O no hydrogen 2.897 N/A VAL 512.A N LEU 508.A O no hydrogen 2.913 N/A PHE 513.A N LYS 509.A O no hydrogen 2.977 N/A VAL 514.A N ILE 510.A O no hydrogen 2.887 N/A GLN 515.A N GLU 511.A O no hydrogen 2.895 N/A THR 516.A N VAL 512.A O no hydrogen 2.967 N/A THR 516.A OG1 VAL 512.A O no hydrogen 2.973 N/A THR 516.A OG1 PHE 513.A O no hydrogen 2.564 N/A LEU 517.A N PHE 513.A O no hydrogen 2.924 N/A LEU 518.A N VAL 514.A O no hydrogen 2.872 N/A HIS 519.A N GLN 515.A O no hydrogen 2.928 N/A LEU 520.A N THR 516.A O no hydrogen 2.962 N/A ALA 521.A N LEU 517.A O no hydrogen 3.023 N/A SER 524.A OG LYS 523.A O no hydrogen 2.314 N/A SER 528.A N SER 524.A O no hydrogen 3.318 N/A SER 528.A OG ALA 521.A O no hydrogen 2.700 N/A SER 528.A OG SER 524.A O no hydrogen 3.483 N/A PHE 529.A N PHE 525.A O no hydrogen 2.914 N/A SER 530.A N SER 526.A O no hydrogen 2.894 N/A SER 530.A OG SER 526.A O no hydrogen 3.143 N/A ALA 531.A N HIS 527.A O no hydrogen 2.880 N/A LEU 532.A N SER 528.A O no hydrogen 2.927 N/A ALA 533.A N PHE 529.A O no hydrogen 2.895 N/A LYS 534.A N SER 530.A O no hydrogen 2.864 N/A PHE 535.A N ALA 531.A O no hydrogen 3.048 N/A HIS 536.A N ALA 533.A O no hydrogen 3.310 N/A GLU 537.A N GLU 537.A OE2 no hydrogen 2.401 N/A LYS 540.A N HIS 536.A O no hydrogen 2.982 N/A THR 541.A N GLU 537.A O no hydrogen 2.930 N/A LEU 542.A N VAL 538.A O no hydrogen 2.892 N/A ALA 543.A N PHE 539.A O no hydrogen 2.834 N/A GLU 547.A N ASP 546.A OD1 no hydrogen 2.948 N/A GLY 548.A N SER 545.A OG no hydrogen 2.871 N/A LYS 549.A N SER 545.A O no hydrogen 3.011 N/A LYS 549.A NZ ALA 543.A O no hydrogen 2.581 N/A LYS 549.A NZ ILE 579.A O no hydrogen 3.242 N/A LEU 550.A N ASP 546.A O no hydrogen 2.905 N/A HIS 551.A N GLU 547.A O no hydrogen 2.901 N/A VAL 552.A N GLY 548.A O no hydrogen 2.901 N/A LEU 553.A N LYS 549.A O no hydrogen 2.962 N/A ARG 554.A N LEU 550.A O no hydrogen 2.868 N/A ARG 554.A NE GLU 593.A OE2 no hydrogen 3.142 N/A VAL 555.A N HIS 551.A O no hydrogen 2.908 N/A MET 556.A N VAL 552.A O no hydrogen 2.907 N/A PHE 557.A N LEU 553.A O no hydrogen 2.909 N/A GLU 558.A N ARG 554.A O no hydrogen 2.924 N/A VAL 559.A N VAL 555.A O no hydrogen 2.936 N/A TRP 560.A N MET 556.A O no hydrogen 3.125 N/A ASN 562.A ND2 THR 458.A O no hydrogen 3.068 N/A ILE 567.A N HIS 563.A O no hydrogen 3.480 N/A ALA 568.A N PRO 564.A O no hydrogen 2.962 N/A VAL 569.A N GLN 565.A O no hydrogen 2.920 N/A LEU 570.A N MET 566.A O no hydrogen 2.834 N/A VAL 571.A N ILE 567.A O no hydrogen 2.935 N/A ASP 572.A N ALA 568.A O no hydrogen 2.919 N/A LYS 573.A N VAL 569.A O no hydrogen 2.957 N/A LYS 573.A NZ THR 577.A OG1 no hydrogen 2.695 N/A MET 574.A N LEU 570.A O no hydrogen 2.910 N/A ILE 575.A N VAL 571.A O no hydrogen 2.927 N/A ARG 576.A N ASP 572.A O no hydrogen 2.953 N/A THR 577.A N LYS 573.A O no hydrogen 2.940 N/A THR 577.A OG1 LYS 573.A O no hydrogen 3.137 N/A GLN 578.A N ILE 575.A O no hydrogen 2.870 N/A ILE 579.A N MET 574.A O no hydrogen 2.729 N/A CYS 582.A SG THR 610.A O no hydrogen 3.940 N/A ALA 584.A N ASP 581.A OD1 no hydrogen 2.913 N/A VAL 585.A N ASP 581.A O no hydrogen 3.312 N/A ALA 586.A N ALA 583.A O no hydrogen 2.980 N/A ASN 587.A N ALA 583.A O no hydrogen 2.928 N/A SER 591.A OG TRP 588.A O no hydrogen 2.540 N/A ASP 597.A N LEU 594.A O no hydrogen 2.910 N/A PHE 598.A N SER 595.A O no hydrogen 3.348 N/A THR 599.A OG1 GLU 418.A OE1 no hydrogen 3.568 N/A ARG 600.A NH1 ASP 597.A OD2 no hydrogen 2.904 N/A LEU 601.A N GLU 427.A OE1 no hydrogen 2.823 N/A GLU 605.A N LEU 601.A O no hydrogen 2.896 N/A ILE 606.A N PHE 602.A O no hydrogen 2.861 N/A LEU 607.A N VAL 603.A O no hydrogen 2.961 N/A HIS 608.A N TRP 604.A O no hydrogen 2.891 N/A SER 609.A N GLU 605.A O no hydrogen 2.883 N/A THR 610.A N ILE 606.A O no hydrogen 2.936 N/A THR 610.A OG1 ILE 606.A O no hydrogen 3.488 N/A THR 610.A OG1 LEU 607.A O no hydrogen 2.545 N/A ILE 611.A N LEU 607.A O no hydrogen 2.994 N/A ARG 612.A N HIS 608.A O no hydrogen 2.867 N/A LYS 613.A N SER 609.A O no hydrogen 2.909 N/A LYS 613.A NZ SER 609.A O no hydrogen 2.647 N/A LYS 613.A NZ SER 609.A OG no hydrogen 2.761 N/A MET 614.A N THR 610.A O no hydrogen 2.954 N/A ASN 615.A N ILE 611.A O no hydrogen 2.894 N/A LYS 616.A N ARG 612.A O no hydrogen 2.893 N/A HIS 617.A N LYS 613.A O no hydrogen 2.897 N/A VAL 618.A N MET 614.A O no hydrogen 2.995 N/A LEU 619.A N ASN 615.A O no hydrogen 2.894 N/A LYS 620.A N LYS 616.A O no hydrogen 2.832 N/A ILE 621.A N HIS 617.A O no hydrogen 2.978 N/A GLN 622.A N VAL 618.A O no hydrogen 2.945 N/A LYS 623.A N LEU 619.A O no hydrogen 2.859 N/A GLU 624.A N LYS 620.A O no hydrogen 2.921 N/A LEU 625.A N ILE 621.A O no hydrogen 2.946 N/A GLU 626.A N GLN 622.A O no hydrogen 2.880 N/A GLU 627.A N LYS 623.A O no hydrogen 2.902 N/A ALA 628.A N GLU 624.A O no hydrogen 2.940 N/A LYS 629.A N LEU 625.A O no hydrogen 2.886 N/A GLU 630.A N GLU 626.A O no hydrogen 2.904 N/A LYS 631.A N GLU 627.A O no hydrogen 2.919 N/A LEU 632.A N ALA 628.A O no hydrogen 2.919 N/A ALA 633.A N LYS 629.A O no hydrogen 2.898 N/A ARG 634.A N GLU 630.A O no hydrogen 2.886 N/A GLN 635.A N LYS 631.A O no hydrogen 2.928 N/A HIS 636.A N LEU 632.A O no hydrogen 2.892 N/A LYS 637.A N ALA 633.A O no hydrogen 2.916 N/A ARG 638.A N ARG 634.A O no hydrogen 2.925 N/A ARG 639.A N GLN 635.A O no hydrogen 2.899 N/A SER 640.A N HIS 636.A O no hydrogen 2.929 N/A SER 640.A OG HIS 636.A O no hydrogen 2.881 N/A SER 640.A OG LYS 637.A O no hydrogen 2.632 N/A ASP 641.A N LYS 637.A O no hydrogen 2.891 N/A ASP 642.A N ARG 639.A O no hydrogen 3.108 N/A GLU 647.A N GLY 643.A O no hydrogen 2.993 N/A GLN 648.A N VAL 644.A O no hydrogen 2.926 N/A ILE 649.A N LEU 645.A O no hydrogen 2.920 N/A GLU 650.A N GLU 646.A O no hydrogen 2.913 N/A ARG 651.A N GLU 647.A O no hydrogen 2.909 N/A LEU 652.A N GLN 648.A O no hydrogen 2.898 N/A GLN 653.A N ILE 649.A O no hydrogen 2.863 N/A GLN 653.A NE2 GLN 653.A O no hydrogen 3.559 N/A GLU 654.A N GLU 650.A O no hydrogen 2.977 N/A LYS 655.A N ARG 651.A O no hydrogen 2.917 N/A VAL 656.A N LEU 652.A O no hydrogen 2.880 N/A GLU 657.A N GLN 653.A O no hydrogen 2.952 N/A SER 658.A N GLU 654.A O no hydrogen 2.946 N/A ALA 659.A N LYS 655.A O no hydrogen 2.893 N/A GLN 660.A N VAL 656.A O no hydrogen 2.903 N/A GLN 660.A NE2 GLN 622.A OE1 no hydrogen 2.646 N/A SER 661.A N GLU 657.A O no hydrogen 2.930 N/A GLU 662.A N SER 658.A O no hydrogen 2.924 N/A GLN 663.A N ALA 659.A O no hydrogen 2.939 N/A GLN 663.A NE2 TYR 718.A OH no hydrogen 3.275 N/A LYS 664.A N GLN 660.A O no hydrogen 2.914 N/A ASN 665.A N SER 661.A O no hydrogen 2.907 N/A LEU 666.A N GLU 662.A O no hydrogen 2.898 N/A PHE 667.A N GLN 663.A O no hydrogen 3.037 N/A LEU 668.A N LYS 664.A O no hydrogen 2.893 N/A VAL 669.A N ASN 665.A O no hydrogen 2.881 N/A ILE 670.A N LEU 666.A O no hydrogen 2.980 N/A PHE 671.A N PHE 667.A O no hydrogen 2.977 N/A GLN 672.A N LEU 668.A O no hydrogen 2.866 N/A ARG 673.A N VAL 669.A O no hydrogen 2.924 N/A PHE 674.A N ILE 670.A O no hydrogen 2.980 N/A ILE 675.A N PHE 671.A O no hydrogen 2.908 N/A MET 676.A N GLN 672.A O no hydrogen 2.900 N/A ILE 677.A N ARG 673.A O no hydrogen 2.936 N/A LEU 678.A N PHE 674.A O no hydrogen 2.941 N/A THR 679.A N ILE 675.A O no hydrogen 2.873 N/A THR 679.A OG1 ILE 675.A O no hydrogen 2.855 N/A GLU 680.A N MET 676.A O no hydrogen 2.937 N/A HIS 681.A N ILE 677.A O no hydrogen 2.944 N/A LEU 682.A N LEU 678.A O no hydrogen 2.889 N/A VAL 683.A N THR 679.A O no hydrogen 2.911 N/A ARG 684.A N GLU 680.A O no hydrogen 2.937 N/A CYS 685.A N HIS 681.A O no hydrogen 2.895 N/A CYS 685.A SG THR 690.A O no hydrogen 2.959 N/A GLU 686.A N LEU 682.A O no hydrogen 2.868 N/A THR 687.A N VAL 683.A O no hydrogen 2.941 N/A THR 687.A OG1 VAL 683.A O no hydrogen 3.385 N/A ASP 688.A N ARG 684.A O no hydrogen 2.902 N/A GLY 689.A N GLU 686.A O no hydrogen 3.074 N/A THR 690.A N CYS 685.A O no hydrogen 3.214 N/A THR 690.A OG1 ASP 688.A O no hydrogen 3.479 N/A SER 691.A OG LEU 693.A O no hydrogen 3.541 N/A LYS 698.A N THR 694.A O no hydrogen 3.049 N/A LYS 698.A NZ MET 381.A O no hydrogen 3.329 N/A ASN 699.A N PRO 695.A O no hydrogen 2.906 N/A ASN 699.A ND2 PRO 695.A O no hydrogen 2.437 N/A CYS 700.A N TRP 696.A O no hydrogen 2.941 N/A ILE 701.A N TYR 697.A O no hydrogen 2.921 N/A GLU 702.A N LYS 698.A O no hydrogen 2.921 N/A ARG 703.A N ASN 699.A O no hydrogen 2.884 N/A ARG 703.A NH1 GLN 706.A OE1 no hydrogen 2.887 N/A ARG 703.A NH2 ASP 387.A OD1 no hydrogen 2.808 N/A LEU 704.A N CYS 700.A O no hydrogen 2.971 N/A GLN 705.A N ILE 701.A O no hydrogen 2.942 N/A GLN 706.A N GLU 702.A O no hydrogen 2.839 N/A ILE 707.A N ARG 703.A O no hydrogen 2.921 N/A PHE 708.A N LEU 704.A O no hydrogen 3.001 N/A LEU 709.A N GLN 705.A O no hydrogen 2.869 N/A GLN 710.A N GLN 706.A O no hydrogen 2.877 N/A HIS 711.A N ILE 707.A O no hydrogen 2.999 N/A HIS 712.A ND1 LEU 709.A O no hydrogen 2.908 N/A ILE 714.A N HIS 711.A O no hydrogen 3.113 N/A ILE 715.A N HIS 711.A O no hydrogen 2.925 N/A GLN 716.A N HIS 712.A O no hydrogen 2.905 N/A GLN 717.A N ILE 714.A O no hydrogen 2.873 N/A LEU 722.A N TYR 718.A O no hydrogen 2.893 N/A GLU 723.A N MET 719.A O no hydrogen 2.919 N/A ASN 724.A N VAL 720.A O no hydrogen 2.924 N/A LEU 725.A N THR 721.A O no hydrogen 2.898 N/A LEU 726.A N LEU 722.A O no hydrogen 3.183 N/A PHE 727.A N LEU 722.A O no hydrogen 2.965 N/A THR 728.A N LEU 726.A O no hydrogen 3.107 N/A LEU 731.A N THR 728.A O no hydrogen 3.125 N/A HIS 734.A N ASP 732.A OD1 no hydrogen 2.581 N/A LEU 736.A N ASP 732.A O no hydrogen 3.059 N/A ALA 737.A N PRO 733.A O no hydrogen 2.902 N/A VAL 738.A N ILE 735.A O no hydrogen 3.100 N/A GLN 740.A N LEU 736.A O no hydrogen 2.932 N/A GLN 741.A N ALA 737.A O no hydrogen 2.886 N/A GLN 741.A NE2 ALA 737.A O no hydrogen 2.877 N/A PHE 742.A N VAL 738.A O no hydrogen 2.918 N/A CYS 743.A N PHE 739.A O no hydrogen 2.899 N/A CYS 743.A SG PHE 739.A O no hydrogen 3.264 N/A ALA 744.A N GLN 740.A O no hydrogen 2.921 N/A LEU 745.A N GLN 741.A O no hydrogen 2.896 N/A LEU 745.A N PHE 742.A O no hydrogen 3.152 N/A GLN 746.A N CYS 743.A O no hydrogen 3.460 N/A GLN 746.A NE2 TYR 258.A O no hydrogen 3.426 N/A